5-[(2-methoxyphenyl)methyl]-2-(3-piperazin-1-ylpropylsulfanyl)pyrimidine-4,6-diamine

Systemtic Name: 5-[(2-methoxyphenyl)methyl]-2-(3-piperazin-1-ylpropylsulfanyl)pyrimidine-4,6-diamine Openeye Name: 5-[(2-methoxyphenyl)methyl]-2-(3-piperazin-1-ylpropylsulfanyl)pyrimidine-4,6-diamine CAS Name: 5-[(2-methoxyphenyl)methyl]-2-[3-(1-piperazinyl)propylthio]pyrimidine-4,6-diamine IUPAC Name: 5-[(2-methoxyphenyl)methyl]-2-(3-piperazin-1-ylpropylsulfanyl)pyrimidine-4,6-diamine Traditional Name: [6-amino-5-o-anisyl-2-(3-piperazinopropylthio)pyrimidin-4-yl]amine Formula: C19H28N6OS MolecularWeight: 388.53022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC2=C(N=C(N=C2N)SCCCN3CCNCC3)N

Isomeric SMILES

COC1=CC=CC=C1CC2=C(N=C(N=C2N)SCCCN3CCNCC3)N

InChI

InChI=1S/C19H28N6OS/c1-26-16-6-3-2-5-14(16)13-15-17(20)23-19(24-18(15)21)27-12-4-9-25-10-7-22-8-11-25/h2-3,5-6,22H,4,7-13H2,1H3,(H4,20,21,23,24)